3,4-Dihydroxybenzenesulfonic acid
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3,4-Dihydroxybenzenesulfonic acid
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CAS No:
7134-09-0
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Formula:
C6H6O5S
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Chemical Name:
3,4-Dihydroxybenzenesulfonic acid
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Synonyms:
Benzenesulfonic acid,3,4-dihydroxy-;3,4-Dihydroxybenzenesulfonic acid;Pyrocatechol-4-sulfonic acid;4-Sulfopyrocatechol;Catechol-4-sulfonic acid;1,2-Dihydroxy-4-benzenesulfonic acid;3,4-Dihydroxybenzene-1-sulfonic acid
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CAS No:
Description
ChEBI: A benzene ring substituted with a sulphonic acid group at position C-1, and hydroxy groups at C-3 and C-4.
3,4-dihydroxybenzenesulfonic acid is a benzene ring substituted with a sulphonic acid group at position C-1, and hydroxy groups at C-3 and C-4. It has a role as a metabolite. It is a conjugate acid of a 3,4-dihydroxybenzenesulfonate.
Computed Properties
Molecular Weight:190.18
XLogP3:0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:189.99359446
Monoisotopic Mass:189.99359446
Topological Polar Surface Area:103
Heavy Atom Count:12
Complexity:241
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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